⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL24102917 | 1.00 | — | — | |
| Alcohol SCHEMBL28915509 | 0.86 | KDM4E (0.31) | — | |
| SCHEMBL29388106 | 0.79 | — | — | |
| SCHEMBL613359 | 0.79 | — | — | |
| SCHEMBL13141244 | 0.78 | — | — | |
| SCHEMBL29042453 | 0.77 | TDP1 (0.48) | — | |
| SCHEMBL719350 | 0.77 | TDP1 (0.55) | — | |
| SCHEMBL29464085 | 0.77 | — | — | |
| SCHEMBL1553731 | 0.77 | — | — | |
| SCHEMBL30586079 | 0.77 | TDP1 (0.48) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114573824-B | Preparation of conductive cobalt coordination linear polymer and application of conductive cobalt coordination linear polymer in electrocatalytic oxygen reduction process | 天津科技大学 | 2023-07-07 | — | — | CN | disclosed |